SCHEMBL19225305

SCHEMBL19225305

CCOC(=O)[C@H](C)NP(C)(=O)N[C@@H](C)C(=O)OCC

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.39
GAA P10253 1/20 0.39
SI P14410 1/20 0.39
MGAM2 Q2M2H8 1/20 0.39
BTN3A1 O00481 4/20 0.39
METAP2 P50579 8/20 0.37
METAP1 P53582 6/20 0.37
ALDH1A1 P00352 3/20 0.37
LMNA P02545 1/20 0.36
HSD17B10 Q99714 1/20 0.36
FBP1 P09467 1/20 0.35
ALOX15 P16050 2/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
CYP3A4 P08684 1/20 0.35
TSHR P16473 1/20 0.35
TDP1 Q9NUW8 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL12746435 1.00 MGAM (0.39) MGAMGAASIMGAM2BTN3A1
SCHEMBL22300550 0.91 BTN3A1 (0.36) MGAMGAASIMGAM2BTN3A1
SCHEMBL13633863 0.88 MGAM (0.39) MGAMGAASIMGAM2BTN3A1
SCHEMBL19225388 0.87 BTN3A1 (0.34) MGAMGAASIMGAM2BTN3A1
SCHEMBL12746431 0.86 BTN3A1 (0.39) MGAMGAASIMGAM2BTN3A1
SCHEMBL14071817 0.84 ACE (0.37) BTN3A1METAP2METAP1
SCHEMBL27494852 0.83 MGAM (0.39) MGAMGAASIMGAM2BTN3A1
SCHEMBL20181544 0.83 MGAM (0.39) MGAMGAASIMGAM2BTN3A1
SCHEMBL28273778 0.83 MGAM (0.39) MGAMGAASIMGAM2BTN3A1
SCHEMBL20181801 0.82 BTN3A1 (0.37) MGAMGAASIMGAM2BTN3A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11325931-B2 Prodrugs of prostate specific membrane antigen (PSMA) inhibitor THE JOHNS HOPKINS UNIVERSITY (US) 2022-05-10 US disclosed
US-20200399298-A1 PRODRUGS OF PROSTATE SPECIFIC MEMBRANE ANTIGEN (PSMA) INHIBITOR THE JOHNS HOPKINS UNIVERSITY 2020-12-24 US disclosed
US-20200069706-A1 PRODRUGS OF 2-PMPA FOR HEALTHY TISSUE PROTECTION DURING PSMA-TARGETED CANCER IMAGING OR RADIOTHERAPY BAYER HEALTHCARE HOLDINGS LLC 2020-03-05 US disclosed
US-10544176-B2 Prodrugs of prostate specific membrane antigen (PSMA) inhibitor THE JOHNS HOPKINS UNIVERSITY (US) 2020-01-28 US disclosed
US-9988407-B2 Prodrugs of prostate specific membrane antigen (PSMA) inhibitor THE JOHNS HOPKINS UNIVERSITY (US) 2018-06-05 US disclosed
US-20170226141-A1 PRODRUGS OF PROSTATE SPECIFIC MEMBRANE ANTIGEN (PSMA) INHIBITOR THE JOHNS HOPKINS UNIVERSITY (US) 2017-08-10 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11325931-B2 Prodrugs of prostate specific membrane antigen (PSMA) inhibitor FOLH1, KLK3, DNPEP MGAM 242/4885GAA 328/4885SI 392/4885
US-20170226141-A1 PRODRUGS OF PROSTATE SPECIFIC MEMBRANE ANTIGEN (PSMA) INHIBITOR FOLH1, KLK3, DNPEP MGAM 242/4885GAA 328/4885SI 392/4885
US-20200399298-A1 PRODRUGS OF PROSTATE SPECIFIC MEMBRANE ANTIGEN (PSMA) INHIBITOR FOLH1, KLK3, DNPEP MGAM 291/4885GAA 241/4885SI 335/4885
US-20200069706-A1 PRODRUGS OF 2-PMPA FOR HEALTHY TISSUE PROTECTION DURING PSMA-TARGETED CANCER IMAGING OR RADIOTHERAPY PLPBP, PTMA, PTPA MGAM 429/4885GAA 398/4885SI 210/4885
US-10544176-B2 Prodrugs of prostate specific membrane antigen (PSMA) inhibitor FOLH1, KLK3, DNPEP MGAM 242/4885GAA 328/4885SI 392/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.